propyl hexanoate (Q3135041)

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chemical compound

n-propyl hexanoaten
caproic acid propyl ester
caproyl acid propyl ester
propyl caproate
hexanoic acid propyl ester
FEMA 2949
N-Propyl hexanoate
N-Propyl N-hexanoate
Hexanoic acid, propyl ester

Language	Label	Description	Also known as
English	propyl hexanoate	chemical compound	n-propyl hexanoaten caproic acid propyl ester caproyl acid propyl ester propyl caproate hexanoic acid propyl ester FEMA 2949 N-Propyl hexanoate N-Propyl N-hexanoate Hexanoic acid, propyl ester

Statements

type of chemical entity

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biogenic acyclic ester

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chemical structure

Propyl-hexanoate.svg
571 × 172; 6 KB

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158.131 dalton

1 reference

language of work or name

PROPYL HEXANOATE (English)

9 October 2016

chemical formula

C₉H₁₈O₂

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language of work or name

PROPYL HEXANOATE (English)

9 October 2016

canonical SMILES

CCCCCC(=O)OCCC

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language of work or name

PROPYL HEXANOATE (English)

9 October 2016

−69.0 degree Celsius

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Jean-Claude Bradley Open Melting Point Dataset

Bothriochloa bladhii

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New Constituents ofBothriochloa bladhi

Commons category

Propyl hexanoate

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Identifiers

InChI=1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3

1 reference

language of work or name

PROPYL HEXANOATE (English)

9 October 2016

HTUIWRWYYVBCFT-UHFFFAOYSA-N

2 references

language of work or name

PROPYL HEXANOATE (English)

9 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

propyl hexanoate (English)

9 October 2016

HTUIWRWYYVBCFT-UHFFFAOYSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=626-77-7

1 reference

language of work or name

Propyl hexanoate (English)

9 October 2016

1 reference

language of work or name

PROPYL HEXANOATE (English)

9 October 2016

Reaxys registry number

1752238

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language of work or name

propyl hexanoate (English)

9 October 2016

mapping relation type

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language of work or name

propyl hexanoate (English)

9 October 2016

UniChem compound ID

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MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP006986

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splash10-0006-9100000000-78e2f22b459e7b745a6c

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DSSTox substance ID

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Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

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210-963-0

1 reference

Global Substance Registration System

language of work or name

PROPYL HEXANOATE (English)

9 October 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Propyl hexanoate (English)

CAS no.: 626-77-7 (English)

09.061

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CAS no.: 626-77-7 (English)

23 January 2021

09.061

Cannabis Database ID

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Cannabis Database

AICS Chemical ID (BEING DELETED)

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Human Metabolome Database ID

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based on heuristic

inferred from InChIKey

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Global Substance Registration System

language of work or name

PROPYL HEXANOATE (English)

9 October 2016

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

30 June 2018

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JECFA database ID

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161

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Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)

13 May 2021

Microsoft Academic ID

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Sitelinks

Wikipedia(8 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(1 entry)

commonswiki Category:Propyl hexanoate

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